N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine

C30H62N4 — CID 15066273

IUPACN,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine
SMILESCC(CC1CC(C)(C)NC(C)(C)C1)NCCCCCCNC(C)CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C30H62N4/c1-23(17-25-19-27(3,4)33-28(5,6)20-25)31-15-13-11-12-14-16-32-24(2)18-26-21-29(7,8)34-30(9,10)22-26/h23-26,31-34H,11-22H2,1-10H3
InChIKeyIEGNMUBUSJCTIX-UHFFFAOYSA-N
MW478.85 g/mol
LogP6.40
Rot. Bonds13

About N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine

N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine (PubChem CID 15066273) has the molecular formula C30H62N4 and a molecular weight of 478.85 g/mol. Its IUPAC name is N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine.

Molecular Properties

Compound NameN,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine
PubChem CID15066273
Molecular FormulaC30H62N4
Molecular Weight478.85 g/mol
Exact Mass478.50
IUPAC NameN,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine
SMILESCC(CC1CC(C)(C)NC(C)(C)C1)NCCCCCCNC(C)CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C30H62N4/c1-23(17-25-19-27(3,4)33-28(5,6)20-25)31-15-13-11-12-14-16-32-24(2)18-26-21-29(7,8)34-30(9,10)22-26/h23-26,31-34H,11-22H2,1-10H3
InChIKeyIEGNMUBUSJCTIX-UHFFFAOYSA-N
XLogP6.40
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.85
LogP ≤ 56.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine?
The IUPAC name of N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine (CID 15066273) is N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine.
What is the SMILES notation for N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine?
The canonical SMILES for N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine is CC(CC1CC(C)(C)NC(C)(C)C1)NCCCCCCNC(C)CC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine?
The InChIKey is IEGNMUBUSJCTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H62N4/c1-23(17-25-19-27(3,4)33-28(5,6)20-25)31-15-13-11-12-14-16-32-24(2)18-26-21-29(7,8)34-30(9,10)22-26/h23-26,31-34H,11-22H2,1-10H3.
What are the key properties of N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine?
N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine has a molecular weight of 478.85 g/mol, XLogP of 6.40, 13 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[1-(2,2,6,6-tetramethylpiperidin-4-yl)propan-2-yl]hexane-1,6-diamine is sourced from PubChem (CID 15066273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).